N-[(2-methoxyphenyl)methyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide

Systemtic Name: N-[(2-methoxyphenyl)methyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonyl-ethyl)ethanediamide Openeye Name: N-[(2-methoxyphenyl)methyl]-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide CAS Name: N-[(2-methoxyphenyl)methyl]-N'-[2-(3-pyridinyl)-2-thiophen-2-ylsulfonylethyl]oxamide IUPAC Name: N-[(2-methoxyphenyl)methyl]-N'-(2-pyridin-3-yl-2-thiophen-2-ylsulfonylethyl)oxamide Traditional Name: N-o-anisyl-N'-[2-(3-pyridyl)-2-(2-thienylsulfonyl)ethyl]oxamide Formula: C21H21N3O5S2 MolecularWeight: 459.53854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CNC(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC1=CC=CC=C1CNC(=O)C(=O)NCC(C2=CN=CC=C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H21N3O5S2/c1-29-17-8-3-2-6-15(17)13-23-20(25)21(26)24-14-18(16-7-4-10-22-12-16)31(27,28)19-9-5-11-30-19/h2-12,18H,13-14H2,1H3,(H,23,25)(H,24,26)